Vitas-M small molecule compound
methyl 7-(furan-3-yl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL173380
SMILES COC(=O)C1=C(C)Nc2n(C1c1cocc1)nc(n2)SC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H14N4O3S MW 306.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3S/c1-7-9(11(18)19-2)10(8-4-5-20-6-8)17-12(14-7)15-13(16-17)21-3/h4-6,10H,1-3H3,(H,14,15,16)InChIKey
YNTPCEPRNKNWEE-UHFFFAOYSA-NSynonyms
866816-36-6866816366
CC1=C(C(N2C(=N1)N=C(N2)SC)C3=COC=C3)C(=O)OC
InChI=1SC13H14N4O3Sc179(11(18)192)10(8452068)1712(147)1513(1617)213h4610H13H3(H141516)
methyl7(furan3yl)5methyl2(methylsulfanyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
methyl7(furan3yl)5methyl2methylsulfanyl17dihydro(124)triazolo(15a)pyrimidine6carboxylate
MFCD06197086
ZINC000036611861
ZINC000036611862
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